1-(2,3-dihydro-1-benzothiophen-6-yl)propan-2-amine

C11H15NS — CID 117284206

IUPAC1-(2,3-dihydro-1-benzothiophen-6-yl)propan-2-amine
SMILESCC(N)Cc1ccc2c(c1)SCC2
InChIInChI=1S/C11H15NS/c1-8(12)6-9-2-3-10-4-5-13-11(10)7-9/h2-3,7-8H,4-6,12H2,1H3
InChIKeyFZYLZFMFASDBAX-UHFFFAOYSA-N
MW193.31 g/mol
LogP2.22
Rot. Bonds2

About 1-(2,3-dihydro-1-benzothiophen-6-yl)propan-2-amine

1-(2,3-dihydro-1-benzothiophen-6-yl)propan-2-amine (PubChem CID 117284206) has the molecular formula C11H15NS and a molecular weight of 193.31 g/mol. Its IUPAC name is 1-(2,3-dihydro-1-benzothiophen-6-yl)propan-2-amine.

Molecular Properties

Compound Name1-(2,3-dihydro-1-benzothiophen-6-yl)propan-2-amine
PubChem CID117284206
Molecular FormulaC11H15NS
Molecular Weight193.31 g/mol
Exact Mass193.09
IUPAC Name1-(2,3-dihydro-1-benzothiophen-6-yl)propan-2-amine
SMILESCC(N)Cc1ccc2c(c1)SCC2
InChIInChI=1S/C11H15NS/c1-8(12)6-9-2-3-10-4-5-13-11(10)7-9/h2-3,7-8H,4-6,12H2,1H3
InChIKeyFZYLZFMFASDBAX-UHFFFAOYSA-N
XLogP2.22
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.31
LogP ≤ 52.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-(2,3-dihydro-1-benzothiophen-6-yl)-1,1-difluoro-N-methylpropan-2-amine
CID 168764150
3-(2,3-dihydro-1-benzothiophen-6-yl)propan-1-amine
CID 82401609
1-(2,3-dihydro-1-benzothiophen-4-yl)propan-2-amine
CID 117284204
1-[8-(2-aminopropyl)dibenzothiophen-2-yl]propan-2-amine
CID 170864486
1-(3-methyl-2,3-dihydro-1H-inden-5-yl)propan-2-amine
CID 117281618
(2R)-1-(3,4-diethylphenyl)propan-2-amine
CID 139743643
6-(2-aminopropyl)-1-methyl-3,4-dihydroquinolin-2-one
CID 82190766
1-(2,2-dimethyl-3H-1-benzofuran-6-yl)propan-2-amine
CID 117294068
1-(3-bromo-4-methylphenyl)propan-2-amine
CID 83710327
4,4-dichloro-3-(2,3-dihydro-1-benzothiophen-6-yl)-N-ethylbutan-2-amine
CID 168763926
4-(3,4-dihydro-2H-thiochromen-6-yl)-3-methylbutan-1-amine
CID 116924895
1-chloro-1-(2,3-dihydro-1-benzothiophen-6-yl)-N-methylpropan-2-amine
CID 168764178

Frequently Asked Questions

What is the IUPAC name of 1-(2,3-dihydro-1-benzothiophen-6-yl)propan-2-amine?
The IUPAC name of 1-(2,3-dihydro-1-benzothiophen-6-yl)propan-2-amine (CID 117284206) is 1-(2,3-dihydro-1-benzothiophen-6-yl)propan-2-amine.
What is the SMILES notation for 1-(2,3-dihydro-1-benzothiophen-6-yl)propan-2-amine?
The canonical SMILES for 1-(2,3-dihydro-1-benzothiophen-6-yl)propan-2-amine is CC(N)Cc1ccc2c(c1)SCC2.
What is the InChIKey of 1-(2,3-dihydro-1-benzothiophen-6-yl)propan-2-amine?
The InChIKey is FZYLZFMFASDBAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NS/c1-8(12)6-9-2-3-10-4-5-13-11(10)7-9/h2-3,7-8H,4-6,12H2,1H3.
What are the key properties of 1-(2,3-dihydro-1-benzothiophen-6-yl)propan-2-amine?
1-(2,3-dihydro-1-benzothiophen-6-yl)propan-2-amine has a molecular weight of 193.31 g/mol, XLogP of 2.22, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,3-dihydro-1-benzothiophen-6-yl)propan-2-amine is sourced from PubChem (CID 117284206), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).